1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone

Systemtic Name: 1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Openeye Name: 1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone CAS Name: 1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone IUPAC Name: 1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Traditional Name: 1-adamantyl-(6,7-dimethoxy-1-phenyl-3,4-dihydro-1H-isoquinolin-2-yl)methanone Formula: C28H33NO3 MolecularWeight: 431.56652

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Descriptors Computed from Structure

Canonical SMILES:

COC1=C(C=C2C(N(CCC2=C1)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)OC

Isomeric SMILES

COC1=C(C=C2C(N(CCC2=C1)C(=O)C34CC5CC(C3)CC(C5)C4)C6=CC=CC=C6)OC

InChI

InChI=1S/C28H33NO3/c1-31-24-13-22-8-9-29(26(21-6-4-3-5-7-21)23(22)14-25(24)32-2)27(30)28-15-18-10-19(16-28)12-20(11-18)17-28/h3-7,13-14,18-20,26H,8-12,15-17H2,1-2H3